1-(4-methyl-4-prop-2-enyl-piperazin-4-ium-1-yl)octan-1-one

Systemtic Name: 1-(4-methyl-4-prop-2-enyl-piperazin-4-ium-1-yl)octan-1-one Openeye Name: 1-(4-allyl-4-methyl-piperazin-4-ium-1-yl)octan-1-one CAS Name: 1-(4-methyl-4-prop-2-enyl-1-piperazin-4-iumyl)-1-octanone IUPAC Name: 1-(4-methyl-4-prop-2-enylpiperazin-4-ium-1-yl)octan-1-one Traditional Name: 1-(4-allyl-4-methyl-piperazin-4-ium-1-yl)octan-1-one Formula: C16H31N2O+ MolecularWeight: 267.43014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CC[N+](CC1)(C)CC=C

Isomeric SMILES

CCCCCCCC(=O)N1CC[N+](CC1)(C)CC=C

InChI

InChI=1S/C16H31N2O/c1-4-6-7-8-9-10-16(19)17-11-14-18(3,13-5-2)15-12-17/h5H,2,4,6-15H2,1,3H3/q+1